In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 15 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.91 | 4.33 | -47.37 | 2 | 4 | 0 | 60 | 214.309 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 6.55 | -97.79 | 3 | 4 | 1 | 61 | 215.317 | 6 | ↓ |